Vitas-M small molecule compound

5-benzyl-6-methyl-2-[(2-methylpropyl)sulfanyl]pyrimidin-4-ol

Catalog ID
STK604737
SMILES CC(CSc1nc(C)c(c(n1)O)Cc1ccccc1)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H20N2OS MW 288.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2OS/c1-11(2)10-20-16-17-12(3)14(15(19)18-16)9-13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3,(H,17,18,19)
InChIKey
KHUBJKGBWYNSNZ-UHFFFAOYSA-N
Synonyms
488797-15-5
488797155
5BENZYL2ISOBUTYLSULFANYL6METHYL3HPYRIMIDIN4ONE
5benzyl6methyl2((2methylpropyl)sulfanyl)pyrimidin4ol
5BENZYL6METHYL2(2METHYLPROPYLSULFANYL)1HPYRIMIDIN4ONE
CC1=C(C(=O)N=C(N1)SCC(C)C)CC2=CC=CC=C2
InChI=1SC16H20N2OSc111(2)1020161712(3)14(15(19)1816)9137546813h4811H910H213H3(H171819)
MFCD08732992
ZINC000008716774
ZINC8716774

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.